3-(4-Hydroxybutoxy)phenylboronic acid
Basic information
- Standard SMILES
OCCCCOc1cccc(B(O)O)c1- InChIKey
MYCSHQGPISXZFT-UHFFFAOYSA-N- Molecular formula
- C10H15BO4
- Average molar mass
- 210.04 g/mol
Names & identifiers
- Preferred name
- 3-(4-Hydroxybutoxy)phenylboronic acid
- IUPAC
- [3-(4-hydroxybutoxy)phenyl]boronic acid
Names & synonyms
SCHEMBL634578MYCSHQGPISXZFT-UHFFFAOYSA-N3-(4-hydroxybutoxy)phenylboronic acid
Database identifiers
- PubChem CID
- 59623529
Properties
Computed structural properties
- Topological polar surface area
- 69.9 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 166
Related reactions
3 records
Compound notes
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